6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine

C11H19N5O — CID 80818618

IUPAC6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(NC2(C)CCCCC2)n1
InChIInChI=1S/C11H19N5O/c1-11(6-4-3-5-7-11)16-9-13-8(12)14-10(15-9)17-2/h3-7H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyGUCSOTPVXVTUIT-UHFFFAOYSA-N
MW237.31 g/mol
LogP1.60
Rot. Bonds3

About 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine

6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80818618) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
PubChem CID80818618
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(NC2(C)CCCCC2)n1
InChIInChI=1S/C11H19N5O/c1-11(6-4-3-5-7-11)16-9-13-8(12)14-10(15-9)17-2/h3-7H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyGUCSOTPVXVTUIT-UHFFFAOYSA-N
XLogP1.60
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(tert-butyl)-N'-cyclohexyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 14651806
1-[[4-Chloro-6-(methoxyamino)-1,3,5-triazin-2-yl]amino]cyclohexane-1-carbonitrile
CID 71727499
1-[[4-Methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]cyclohexane-1-carbonitrile
CID 71727505
4,6-dimethoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 19832808
2-N-(2-methylheptan-2-yl)-1,3,5-triazine-2,4,6-triamine
CID 20352072
2-N,4-N-bis(1-methylcyclohexyl)-1,3,5-triazine-2,4,6-triamine
CID 23295152
2-N-(3-methylheptan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 57140276
2-N-(3-ethyloctan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 69865502
4,6-dimethoxy-N-(7-methyltetradecan-7-yl)-1,3,5-triazin-2-amine
CID 169970573
4-chloro-6-ethoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 55124418
4-chloro-N-(cyclohexylmethyl)-6-methoxy-1,3,5-triazin-2-amine
CID 55124638
6-chloro-2-N,2-N-dimethyl-4-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 55125514

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine (CID 80818618) is 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine is COc1nc(N)nc(NC2(C)CCCCC2)n1.
What is the InChIKey of 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is GUCSOTPVXVTUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-11(6-4-3-5-7-11)16-9-13-8(12)14-10(15-9)17-2/h3-7H2,1-2H3,(H3,12,13,14,15,16).
What are the key properties of 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine?
6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 237.31 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80818618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).